4-(5-phenyl-1-propyl-1,2,4-triazin-1-ium-3-yl)morpholine

Systemtic Name: 4-(5-phenyl-1-propyl-1,2,4-triazin-1-ium-3-yl)morpholine Openeye Name: 4-(5-phenyl-1-propyl-1,2,4-triazin-1-ium-3-yl)morpholine CAS Name: 4-(5-phenyl-1-propyl-1,2,4-triazin-1-ium-3-yl)morpholine IUPAC Name: 4-(5-phenyl-1-propyl-1,2,4-triazin-1-ium-3-yl)morpholine Traditional Name: 4-(5-phenyl-1-propyl-1,2,4-triazin-1-ium-3-yl)morpholine Formula: C16H21N4O+ MolecularWeight: 285.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=NC(=NC(=C1)C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCC[N+]1=NC(=NC(=C1)C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C16H21N4O/c1-2-8-20-13-15(14-6-4-3-5-7-14)17-16(18-20)19-9-11-21-12-10-19/h3-7,13H,2,8-12H2,1H3/q+1